B3IXJ4
-OEChem-04012114542D
58 60 0 0 0 0 0 0 0999 V2000
14.5933 -2.7446 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.5900 2.4099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.2651 -2.2279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2358 1.3300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.8231 -1.3273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.2246 -1.8866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.1369 -0.7313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6123 2.1118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8705 0.3991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8481 0.6972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2246 1.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6235 1.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8816 0.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4142 -0.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8231 0.9197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6049 0.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6049 -0.7038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8481 -1.1047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5163 -0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4988 0.8309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4988 -1.2384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4049 -0.7246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4049 0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2690 -1.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.0010 -1.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.8690 -0.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.9972 -2.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.7331 -1.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.8613 -2.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.7292 -2.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1568 2.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4149 2.6995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8550 -0.2207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4782 0.2763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0790 1.6662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8210 1.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8971 0.8699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2739 0.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9295 0.1828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9295 -0.5903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9610 1.5242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4847 3.1312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6134 3.2293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5153 2.3580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9392 -0.4543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2898 -1.2579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0934 -0.9073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4917 1.4508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4917 -1.8584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9406 0.6291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6116 -1.7942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4512 -2.4637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1393 -0.1113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.8714 -0.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4590 -2.5425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2712 -0.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.8589 -3.3579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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30 58 1 0 0 0 0
M END
$$$$